Dianthramine

Base Information

• Chemical Name: Dianthramine
• CAS No.: 136945-65-8
• Molecular Formula: C14H11 N O6
• Molecular Weight: 289.2402
• DSSTox Substance ID: DTXSID30331591
• Nikkaji Number: J2.766.051G
• Wikidata: Q27106400
• Metabolomics Workbench ID: 68853
• Mol file: 136945-65-8.mol

Synonyms:Dianthramine;136945-65-8;2-(2-carboxy-5-hydroxyanilino)-4-hydroxybenzoic acid;2,2'-Azanediylbis(4-hydroxybenzoic acid);C08478;2,2'-Iminobis(4-hydroxybenzoic acid);Benzoic acid, 2,2'-iminobis[4-hydroxy-;AC1L9BBP;CHEBI:4492;DTXSID30331591;CS-0379366;Q27106400;2-(2-carboxy-5-hydroxy-anilino)-4-hydroxy-benzoic acid

Chemical Property of Dianthramine

Chemical Property:

• Boiling Point: 541.9oC at 760 mmHg
• Flash Point: 281.6oC
• PSA: 127.09000
• Density: 1.63g/cm3
• LogP: 2.31080
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 289.05863707
• Heavy Atom Count: 21
• Complexity: 365

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1O)NC2=C(C=CC(=C2)O)C(=O)O)C(=O)O